Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 16/20 | 0.63 |
| ▸ | ERBB2 | P04626 | 6/20 | 0.61 |
| ▸ | KDR | P35968 | 4/20 | 0.58 |
| ▸ | EPHB4 | P54760 | 3/20 | 0.58 |
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
| ▸ | INSR | P06213 | 1/20 | 0.58 |
| ▸ | FBP1 | P09467 | 1/20 | 0.58 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.58 |
| ▸ | FLT4 | P35916 | 1/20 | 0.58 |
| ▸ | CLK1 | P49759 | 1/20 | 0.58 |
| ▸ | TEK | Q02763 | 1/20 | 0.58 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.58 |
| ▸ | EPHA2 | P29317 | 2/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.53 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2781493 | 1.00 | EGFR (0.63) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL169433 | 0.94 | EGFR (0.70) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL29623600 | 0.94 | EGFR (0.70) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL208516 | 0.94 | EGFR (0.70) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL29623753 | 0.94 | EGFR (0.70) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL208538 | 0.94 | EGFR (0.70) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL174651 | 0.94 | EGFR (0.70) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL29623520 | 0.94 | EGFR (0.70) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL168960 | 0.94 | EGFR (0.70) | EGFRERBB2KDREPHB4AURKA | |
| SCHEMBL1919780 | 0.90 | ERBB2 (0.65) | EGFRERBB2KDREPHB4AURKA |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2408500-A1 | DISPENSING DEVICE, STORAGE DEVICE AND METHOD FOR DISPENSING A FORMULATION | Boehringer Ingelheim International GmbH (DE) | 2012-01-25 | — | — | EP | disclosed |
| EP-2393492-A1 | NEW PHARMACEUTICAL COMPOSITIONS FOR TREATMENT OF RESPIRATORY AND GASTROINTESTINAL DISORDERS | Boehringer Ingelheim International GmbH (DE) | 2011-12-14 | — | — | EP | disclosed |
| EP-2285440-A2 | INHALER | Boehringer Ingelheim International GmbH (DE) | 2011-02-23 | — | — | EP | disclosed |
| WO-2010089391-A1 | NEW PHARMACEUTICAL COMPOSITIONS FOR TREATMENT OF RESPIRATORY AND GASTROINTESTINAL DISORDERS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-08-12 | — | — | WO | disclosed |